2-[(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C18H13ClN4O2S2 MolecularWeight: 416.90442

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C18H13ClN4O2S2/c1-2-6-23-17(25)11-4-3-10(19)8-13(11)21-18(23)27-9-14-20-12-5-7-26-15(12)16(24)22-14/h2-5,7-8H,1,6,9H2,(H,20,22,24)